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Taking Ockham's razor to enzyme dynamics and catalysis

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Year: 2012
Type: article
Source: Nature Chemistry
DOI: 10.1038/nchem.1244
Authors: David R. Glowacki, Jeremy N. Harvey, Adrian J. Mulholland
Institution: University of Bristol
Language: English

Topic: Protein Structure and Dynamics
Subfield: Molecular Biology
Field: Biochemistry, Genetics and Molecular Biology
Domain: Life Sciences

Open Access status: closed

Funder: Engineering and Physical Sciences Research Council
Awards: New Horizons in Chemical and Photochemical Dynamics, CCP-BioSim: Biomolecular simulation at the life sciences interface, G4799187780, Combined experimental and computational investigations of a nucleophilic displacement reaction with a hydride leaving group, Adaptive Multi-Resolution Massively-Multicore Hybrid Dynamics, Combined quantum mechanics/molecular mechanics (QM/MM) Monte Carlo free energy simulations: a feasibility study, Multiscale Ensemble Computing for Modelling Biological Catalysts, Computational biochemistry: predictive modelling for biology and medicine
OpenAlex ID: W1984276856
FWCI: 10.5
Cites: 84
Cited by: 230
Related to: 10
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